N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-3-chloranyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-3-chloranyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-3-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[[4-(aminomethyl)phenyl]methylamino]-oxomethyl]-3-chlorophenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-3-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[4-(aminomethyl)benzyl]carbamoyl]-3-chloro-phenyl]thiophene-2-carboxamide Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NC2=CC(=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN)Cl

Isomeric SMILES

C1=CSC(=C1)C(=O)NC2=CC(=C(C=C2)C(=O)NCC3=CC=C(C=C3)CN)Cl

InChI

InChI=1S/C20H18ClN3O2S/c21-17-10-15(24-20(26)18-2-1-9-27-18)7-8-16(17)19(25)23-12-14-5-3-13(11-22)4-6-14/h1-10H,11-12,22H2,(H,23,25)(H,24,26)