10,20-dihexyl-15-(1,3,5-trithian-2-yl)-21,22-dihydroporphyrin

Systemtic Name: 10,20-dihexyl-15-(1,3,5-trithian-2-yl)-21,22-dihydroporphyrin Openeye Name: 10,20-dihexyl-15-(1,3,5-trithian-2-yl)-21,22-dihydroporphyrin CAS Name: 10,20-dihexyl-15-(1,3,5-trithian-2-yl)-21,22-dihydroporphyrin IUPAC Name: 10,20-dihexyl-15-(1,3,5-trithian-2-yl)-21,22-dihydroporphyrin Traditional Name: 10,20-dihexyl-15-(1,3,5-trithian-2-yl)-21,22-dihydroporphine Formula: C35H42N4S3 MolecularWeight: 614.92978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C=CC(=CC3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C6SCSCS6)CCCCCC)N2

Isomeric SMILES

CCCCCCC1=C2C=CC(=CC3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C6SCSCS6)CCCCCC)N2

InChI

InChI=1S/C35H42N4S3/c1-3-5-7-9-11-26-28-15-13-24(36-28)21-25-14-16-29(37-25)27(12-10-8-6-4-2)31-18-20-33(39-31)34(32-19-17-30(26)38-32)35-41-22-40-23-42-35/h13-21,35-37H,3-12,22-23H2,1-2H3