(S)-1-adamantyl-[[5-(4-methylphenyl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]amino]methanol

Systemtic Name: (S)-1-adamantyl-[[5-(4-methylphenyl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]amino]methanol Openeye Name: (S)-1-adamantyl-[[4-allyl-5-(p-tolyl)-1,3,4-thiadiazin-2-yl]amino]methanol CAS Name: (S)-1-adamantyl-[[5-(4-methylphenyl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]amino]methanol IUPAC Name: (S)-1-adamantyl-[[5-(4-methylphenyl)-4-prop-2-enyl-1,3,4-thiadiazin-2-yl]amino]methanol Traditional Name: (S)-1-adamantyl-[[4-allyl-5-(p-tolyl)-1,3,4-thiadiazin-2-yl]amino]methanol Formula: C24H31N3OS MolecularWeight: 409.58744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=NN2CC=C)NC(C34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=NN2CC=C)N[C@H](C34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C24H31N3OS/c1-3-8-27-21(20-6-4-16(2)5-7-20)15-29-23(26-27)25-22(28)24-12-17-9-18(13-24)11-19(10-17)14-24/h3-7,15,17-19,22,28H,1,8-14H2,2H3,(H,25,26)/t17?,18?,19?,22-,24?/m0/s1