azane; 1,3-bis(6-isocyanatohexyl)-1-(6-isocyanatohexylcarbamoyl)urea; methyl 2-methylprop-2-enoate; 2-sulfanylethanol

Systemtic Name: azane; 1,3-bis(6-isocyanatohexyl)-1-(6-isocyanatohexylcarbamoyl)urea; methyl 2-methylprop-2-enoate; 2-sulfanylethanol Openeye Name: ammonia; 1,3-bis(6-isocyanatohexyl)-1-(6-isocyanatohexylcarbamoyl)urea; methyl 2-methylprop-2-enoate; 2-sulfanylethanol CAS Name: ammonia; 1,3-bis(6-isocyanatohexyl)-1-[(6-isocyanatohexylamino)-oxomethyl]urea; 2-mercaptoethanol; 2-methyl-2-propenoic acid methyl ester IUPAC Name: azane; 1,3-bis(6-isocyanatohexyl)-1-(6-isocyanatohexylcarbamoyl)urea; methyl 2-methylprop-2-enoate; 2-sulfanylethanol Traditional Name: ammonia; 1,3-bis(6-isocyanatohexyl)-1-(6-isocyanatohexylcarbamoyl)urea; 2-mercaptoethanol; 2-methylacrylic acid methyl ester Formula: C30H55N7O8S MolecularWeight: 673.8648

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OC.C(CCCN=C=O)CCNC(=O)N(CCCCCCN=C=O)C(=O)NCCCCCCN=C=O.C(CS)O.N

Isomeric SMILES

CC(=C)C(=O)OC.C(CCCN=C=O)CCNC(=O)N(CCCCCCN=C=O)C(=O)NCCCCCCN=C=O.C(CS)O.N

InChI

InChI=1S/C23H38N6O5.C5H8O2.C2H6OS.H3N/c30-19-24-13-7-1-3-10-16-27-22(33)29(18-12-6-5-9-15-26-21-32)23(34)28-17-11-4-2-8-14-25-20-31;1-4(2)5(6)7-3;3-1-2-4;/h1-18H2,(H,27,33)(H,28,34);1H2,2-3H3;3-4H,1-2H2;1H3